⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2452984 | 1.00 | — | — | |
| SCHEMBL2452992 | 1.00 | — | — | |
| SCHEMBL2452982 | 1.00 | — | — | |
| SCHEMBL13456946 | 1.00 | — | — | |
| SCHEMBL2452987 | 1.00 | — | — | |
| SCHEMBL2450838 | 0.94 | KDM4E (0.30) | — | |
| SCHEMBL2450843 | 0.94 | KDM4E (0.30) | — | |
| SCHEMBL2450841 | 0.94 | KDM4E (0.30) | — | |
| SCHEMBL2450839 | 0.94 | KDM4E (0.30) | — | |
| SCHEMBL2453075 | 0.94 | KDM4E (0.30) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110224186-A1 | CARBACEPHEM BETA-LACTAM ANTIBIOTICS | ACHAOGEN, INC. (US) | 2011-09-15 | — | — | US | disclosed |